Rotigotine
(6S)-6-[propyl(2-thiophen-2-ylethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
| Molecular Formula | C19H25NOS |
|---|---|
| Molecular Weight | 315.5 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 51.7 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 315.16568 |
| Heavy Atoms | 22 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 99755-59-6 |
|---|---|
| SMILES | CCCN(CCC1=CC=CS1)C2CCC3=C(C2)C=CC=C3O |
| InChIKey | KFQYTPMOWPVWEJ-INIZCTEOSA-N |
📖 Product Overview
Rotigotine (CAS: 99755-59-6) is a chemical compound with molecular formula C19H25NOS and molecular weight 315.5 g/mol. Its IUPAC systematic name is (6S)-6-[propyl(2-thiophen-2-ylethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol.
KFQYTPMOWPVWEJ-INIZCTEOSA-N.
SMILES: CCCN(CCC1=CC=CS1)C2CCC3=C(C2)C=CC=C3O.
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